(E)-N-[2-cyanoethyl-(phenylmethyl)carbamothioyl]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[2-cyanoethyl-(phenylmethyl)carbamothioyl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[benzyl(2-cyanoethyl)carbamothioyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[[2-cyanoethyl-(phenylmethyl)amino]-sulfanylidenemethyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[benzyl(2-cyanoethyl)carbamothioyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[benzyl(2-cyanoethyl)thiocarbamoyl]-3-phenyl-acrylamide Formula: C20H19N3OS MolecularWeight: 349.44936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCC#N)C(=S)NC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CN(CCC#N)C(=S)NC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C20H19N3OS/c21-14-7-15-23(16-18-10-5-2-6-11-18)20(25)22-19(24)13-12-17-8-3-1-4-9-17/h1-6,8-13H,7,15-16H2,(H,22,24,25)/b13-12+